6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one
TL;DR: 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one (CAS 37473-19-1) is a chemical compound with molecular formula C9H7IN2OS and molecular weight 317.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-3-methyl-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 6-iodo-3-methyl-2-sulfanylidene-1H-quinazolin-4-one, 6-iodo-2-mercapto-3-methylquinazolin-4(3H)-one, 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one
| Molecular Formula | C9H7IN2OS |
|---|---|
| Molecular Weight | 317.93 g/mol |
| LogP | 2.20069 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 317.93237 |
| Heavy Atoms | 14 |
| Complexity | 614.21857 |
Chemical Identifiers
| CAS Number | 37473-19-1 |
|---|---|
| SMILES | CN1C(=O)C2=C(C=CC(=C2)I)NC1=S |
Product Overview
6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one (CAS 37473-19-1), with molecular formula C9H7IN2OS and molecular weight 317.93 g/mol. IUPAC: 6-iodo-3-methyl-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one
Property Insights of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one
The XLogP value of 2.20069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 37.79 Ų, 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one?
The CAS number of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one is 37473-19-1.
What is the molecular formula of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one?
The molecular formula of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one is C9H7IN2OS.
What is the molecular weight of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one?
The molecular weight of 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one is 317.93 g/mol.
Where can I buy 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one?
You can request a quote for 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-iodo-3-methyl-2-sulfanylquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.